CHEBI:62079 - propane-2-sulphonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name propane-2-sulphonic acid
ChEBI ID CHEBI:62079
Definition An alkanesulfonic acid in which the sulfonic acid group is attached to a propan-2-yl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C3H8O3S
Net Charge 0
Average Mass 124.15900
Monoisotopic Mass 124.01942
InChI InChI=1S/C3H8O3S/c1-3(2)7(4,5)6/h3H,1-2H3,(H,4,5,6)
InChIKey HNDXKIMMSFCCFW-UHFFFAOYSA-N
SMILES CC(C)S(O)(=O)=O
ChEBI Ontology
Outgoing propane-2-sulphonic acid (CHEBI:62079) is a alkanesulfonic acid (CHEBI:47901)
propane-2-sulphonic acid (CHEBI:62079) is conjugate acid of propane-2-sulfonate (CHEBI:62080)
Incoming propane-2-sulfonate (CHEBI:62080) is conjugate base of propane-2-sulphonic acid (CHEBI:62079)
IUPAC Name
propane-2-sulphonic acid
Synonyms Sources
2-propanesulfonic acid ChEBI
isopropanesulfonic acid ChEBI
isopropylsulfonic acid ChEBI
propane-2-sulphonic acid ChemIDplus
Registry Numbers Types Sources
14159-48-9 CAS Registry Number ChemIDplus
1747486 Reaxys Registry Number Reaxys
Last Modified
13 May 2011